SCHEMBL23979689

SCHEMBL23979689

CSc1nc(Cl)c2c(n1)NCCC2

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
UHRF1 Q96T88 1/20 0.44
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42
HTR2B P41595 2/20 0.42
CHRM3 P20309 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
KMT2A Q03164 2/20 0.32
ADRB1 P08588 1/20 0.32
ABCB1 P08183 1/20 0.31
IGF1R P08069 1/20 0.31
GAA P10253 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29478982 1.00 UHRF1 (0.44) UHRF1HTR2AHTR2CHTR2BCHRM3
SCHEMBL13811660 0.90 HTR2A (0.43) UHRF1HTR2AHTR2CHTR2B
SCHEMBL29479047 0.90 HTR2A (0.43) UHRF1HTR2AHTR2CHTR2B
SCHEMBL16916371 0.77 UHRF1 (0.46) UHRF1CHRM3PDE4APDE4BPDE4C
SCHEMBL9039446 0.74 UHRF1 (0.43) UHRF1CHRM3PDE4APDE4BPDE4C
SCHEMBL29478998 0.72 HTR7 (0.38) UHRF1
SCHEMBL24373281 0.72 HTR7 (0.38) UHRF1
SCHEMBL857098 0.72 KMT2A (0.46) HTR2AHTR2CHTR2BKMT2AABCB1
SCHEMBL26660095 0.72 KMT2A (0.49) HTR2AHTR2CHTR2BKMT2AABCB1
SCHEMBL4425833 0.70 CHRM3 (0.58) UHRF1CHRM3PDE4APDE4BPDE4C

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240059703-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE AMGEN INC. 2024-02-22 US disclosed
CN-116194456-A Preparation of heterocyclic compounds as KRAS inhibitors and methods of use thereof 上海科州药物研发有限公司 2023-05-30 CN disclosed
WO-2022083569-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2022-04-28 WO disclosed
WO-2021219072-A1 PREPARATION AND APPLICATION METHOD OF HETEROCYCLIC COMPOUND AS KRAS INHIBITOR 上海科州药物研发有限公司 (CN) 2021-11-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240059703-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE KRAS, HRAS, APC UHRF1 3549/4885HTR2A 4665/4885HTR2C 3523/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.